============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 24.879 11.320 19.250 -99.200 -91.000 TRP6 6 1.020 27.205 11.457 18.873 -99.200 -91.000 TRP 42 1.040 -0.828 41.022 13.724 -99.200 -91.000 TRP6 42 1.020 0.589 42.243 12.289 -99.200 -91.000 PHE 53 1.000 18.363 42.277 11.708 -99.200 -91.000 TYR 59 0.840 0.071 36.647 15.894 -99.200 -91.000 HIS 69 0.900 7.388 18.820 30.003 -99.200 -91.000 PHE 99 1.000 29.095 22.013 29.226 -99.200 -91.000